Hydrogen absorption energy diagrams calculations for niobium and vanadium
收藏DataCite Commons2025-11-12 更新2025-04-10 收录
下载链接：
https://edatos.consorciomadrono.es/citation?persistentId=doi:10.21950/QCAHIZ
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资源简介：
This dataset contains the input files INCAR (solver input), POSCAR (atomic position input), POTCAR (atomic potentials input) and MODECAR (dimer input).
This dataset contains the output files CONTCAR/CENTCAR (atomic position output), OUTCAR (energetic output), #run.out (convergence output), NEWMODECAR and dimcar (dimer output).
提供机构：
e-cienciaDatos
创建时间：
2023-11-10
